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Ethanol → 7-[2-(3-Methoxy-2-propoxyphenyl)ethenyl]-6-[4-(trifluoromethyl)phenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

HRID 96130
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인쇄 미리보기

반응식

HRID 96130 반응식
[CH3:1][c:2]1[n:3][c:4]2[n:5]([c:6](=[O:18])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1)[cH:19][cH:20][s:21]2.[CH3:22][O:23][c:24]1[c:25]([O:32][CH2:33][CH2:34][CH3:35])[c:26]([CH:27]=[O:28])[cH:29][cH:30][cH:31]1.[CH3:37][CH2:38][O-:39].[CH3:40][CH2:41][OH:42].[Na+:36]>>[CH:1]([c:2]1[n:3][c:4]2[n:5]([c:6](=[O:18])[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1)[cH:19][cH:20][s:21]2)=[CH:27][c:26]1[c:25]([O:32][CH2:33][CH2:34][CH3:35])[c:24]([O:23][CH3:22])[cH:31][cH:30][cH:29]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 923Sodium IonHCID 1194401-Hydroxyethyl radicalHCID 31593253-Methoxy-2-propoxybenzaldehydeHCID 667528027-Methyl-6-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

생성물 1

HCID 667531217-[2-(3-Methoxy-2-propoxyphenyl)ethenyl]-6-[4-(trifluoromethyl)phenyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

출처 및 근거

ORD 기록
ord-fe6de2f2fcf943788f56b16b4f758cda
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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